N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine

C12H28N2 — CID 63964315

IUPACN,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine
SMILESCCC(C)(C)N(C)CC(C)(C)CNC
InChIInChI=1S/C12H28N2/c1-8-12(4,5)14(7)10-11(2,3)9-13-6/h13H,8-10H2,1-7H3
InChIKeyZSBFJISDUPPDCD-UHFFFAOYSA-N
MW200.37 g/mol
LogP2.35
Rot. Bonds6

About N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine

N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine (PubChem CID 63964315) has the molecular formula C12H28N2 and a molecular weight of 200.37 g/mol. Its IUPAC name is N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine.

Molecular Properties

Compound NameN,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine
PubChem CID63964315
Molecular FormulaC12H28N2
Molecular Weight200.37 g/mol
Exact Mass200.23
IUPAC NameN,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine
SMILESCCC(C)(C)N(C)CC(C)(C)CNC
InChIInChI=1S/C12H28N2/c1-8-12(4,5)14(7)10-11(2,3)9-13-6/h13H,8-10H2,1-7H3
InChIKeyZSBFJISDUPPDCD-UHFFFAOYSA-N
XLogP2.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.37
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine?
The IUPAC name of N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine (CID 63964315) is N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine.
What is the SMILES notation for N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine?
The canonical SMILES for N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine is CCC(C)(C)N(C)CC(C)(C)CNC.
What is the InChIKey of N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine?
The InChIKey is ZSBFJISDUPPDCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2/c1-8-12(4,5)14(7)10-11(2,3)9-13-6/h13H,8-10H2,1-7H3.
What are the key properties of N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine?
N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine has a molecular weight of 200.37 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N',2,2-tetramethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine is sourced from PubChem (CID 63964315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).